6-(1,3-benzodioxol-5-ylamino)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(1,3-benzodioxol-5-ylamino)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(1,3-benzodioxol-5-ylamino)-6-oxo-hexanoic acid CAS Name: 6-(1,3-benzodioxol-5-ylamino)-6-oxohexanoic acid IUPAC Name: 6-(1,3-benzodioxol-5-ylamino)-6-oxohexanoic acid Traditional Name: 6-(1,3-benzodioxol-5-ylamino)-6-keto-hexanoic acid Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CCCCC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C13H15NO5/c15-12(3-1-2-4-13(16)17)14-9-5-6-10-11(7-9)19-8-18-10/h5-7H,1-4,8H2,(H,14,15)(H,16,17)